SCHEMBL4869823

SCHEMBL4869823

O=Cc1cc2c3c(c1)CCN3CCC2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.48
MEN1 O00255 5/20 0.48
RAD52 P43351 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
ALDH1A1 P00352 11/20 0.46
MAPT P10636 5/20 0.46
HPGD P15428 4/20 0.46
GAA P10253 3/20 0.46
TRIM24 O15164 1/20 0.44
TRIM33 Q9UPN9 1/20 0.44
KDM4E B2RXH2 5/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
POLB P06746 3/20 0.42
RECQL P46063 3/20 0.42
TDP1 Q9NUW8 3/20 0.42
BLM P54132 2/20 0.42
GFER P55789 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ALDH1A3 P47895 4/20 0.39
LMNA P02545 2/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL254935 0.96 KMT2A (0.50) KMT2AMEN1RAD52RXFP1ALDH1A1
SCHEMBL13989159 0.80 KMT2A (0.53) KMT2AMEN1RAD52RXFP1ALDH1A1
SCHEMBL2839306 0.79 ALDH1A1 (0.45) KMT2AMEN1RAD52RXFP1ALDH1A1
SCHEMBL15882807 0.79 KMT2A (0.45) KMT2AMEN1RAD52RXFP1ALDH1A1
SCHEMBL15882809 0.79 KMT2A (0.45) KMT2AMEN1RAD52RXFP1ALDH1A1
SCHEMBL15267534 0.77 KMT2A (0.50) KMT2AMEN1RAD52RXFP1ALDH1A1
SCHEMBL10396166 0.76 ALDH1A1 (0.39) KMT2AMEN1RAD52RXFP1ALDH1A1
SCHEMBL14366795 0.76 KMT2A (0.49) KMT2AMEN1RAD52RXFP1ALDH1A1
SCHEMBL13989158 0.76 KMT2A (0.49) KMT2AMEN1RAD52RXFP1ALDH1A1
SCHEMBL2837705 0.75 ALDH1A1 (0.39) KMT2AMEN1ALDH1A1MAPTHPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7316878-B2 Hydrazone-based charge transport materials having an unsaturated acyl group SAMSUNG ELECTRONICS CO., LTD. (KR) 2008-01-08 US disclosed
US-20060046171-A1 Hydrazone-based charge transport materials having an unsaturated acyl group S-PRINTING SOLUTION CO., LTD. (KR) 2006-03-02 US disclosed